2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine

C13H19BrN2 — CID 107190834

IUPAC2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine
SMILESCC1CCCC1C(N)Cc1ccc(Br)cn1
InChIInChI=1S/C13H19BrN2/c1-9-3-2-4-12(9)13(15)7-11-6-5-10(14)8-16-11/h5-6,8-9,12-13H,2-4,7,15H2,1H3
InChIKeyKSGAYZRMDDRTMK-UHFFFAOYSA-N
MW283.21 g/mol
LogP3.15
Rot. Bonds3

About 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine

2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine (PubChem CID 107190834) has the molecular formula C13H19BrN2 and a molecular weight of 283.21 g/mol. Its IUPAC name is 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine.

Molecular Properties

Compound Name2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine
PubChem CID107190834
Molecular FormulaC13H19BrN2
Molecular Weight283.21 g/mol
Exact Mass282.07
IUPAC Name2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine
SMILESCC1CCCC1C(N)Cc1ccc(Br)cn1
InChIInChI=1S/C13H19BrN2/c1-9-3-2-4-12(9)13(15)7-11-6-5-10(14)8-16-11/h5-6,8-9,12-13H,2-4,7,15H2,1H3
InChIKeyKSGAYZRMDDRTMK-UHFFFAOYSA-N
XLogP3.15
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.21
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethyl]propan-1-amine
CID 107190842
2-(5-bromo-2-pyridinyl)-1-cyclohexylethanamine
CID 104801170
2-(5-bromo-2-pyridinyl)-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 104802559
2-(5-bromo-2-pyridinyl)-1-(3-methyl-1,4-dithian-2-yl)ethanamine
CID 104803700
2-(5-bromo-3-pyridinyl)-1-(2-methylcyclopentyl)ethanamine
CID 107190850
1-(5-bromo-2-pyridinyl)-3-cyclobutyl-N-ethylpropan-2-amine
CID 103169483
2-(5-bromo-2-pyridinyl)-1-(1-methylcyclopentyl)ethanamine
CID 105036053
1-cyclopentyl-2-(5-methyl-2-pyridinyl)ethanamine
CID 66446145
[2-[(5-bromo-2-pyridinyl)methyl]cyclopentyl]methanamine
CID 104813752
N-[(5-bromo-2-pyridinyl)methyl]-N,2-dimethylcyclohexan-1-amine
CID 115641197
1-(2-methylcyclopentyl)-2-(5-methyl-2-pyridinyl)ethanol
CID 107186175
2-(5-bromo-2-pyridinyl)-1-(1-methoxy-3-methylcyclohexyl)ethanamine
CID 116767724

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine?
The IUPAC name of 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine (CID 107190834) is 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine.
What is the SMILES notation for 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine?
The canonical SMILES for 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine is CC1CCCC1C(N)Cc1ccc(Br)cn1.
What is the InChIKey of 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine?
The InChIKey is KSGAYZRMDDRTMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19BrN2/c1-9-3-2-4-12(9)13(15)7-11-6-5-10(14)8-16-11/h5-6,8-9,12-13H,2-4,7,15H2,1H3.
What are the key properties of 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine?
2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine has a molecular weight of 283.21 g/mol, XLogP of 3.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromo-2-pyridinyl)-1-(2-methylcyclopentyl)ethanamine is sourced from PubChem (CID 107190834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).